1-Ethyl-3-{(1S,4S)-4-[1-(4-methoxyphenyl)-3,5-dimethyl-1H-pyrazol-4-yl]-2-cyclopenten-1-yl}urea
12144
Reference
1-Ethyl-3-{(1S,4S)-4-[1-(4-methoxyphenyl)-3,5-dimethyl-1H-pyrazol-4-yl]-2-cyclopenten-1-yl}urea Structure
Systematic / IUPAC Name: 1-Ethyl-3-[(1S,4S)-4-[1-(4-methoxyphenyl)-3,5-dimethylpyrazol-4-yl]cyclopent-2-en-1-yl]urea
ID: Reference12144
Other Names: NAT16-352850
Formula: C20H26N4O2
Spectral Data
1-Ethyl-3-{(1S,4S)-4-[1-(4-methoxyphenyl)-3,5-dimethyl-1H-pyrazol-4-yl]-2-cyclopenten-1-yl}urea mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Available MS Data
| Used Instruments | Orbitrap Fusion Lumos with ETD LBP |
| No. of Spectral Trees | 1 |
| No. of Spectra | 1268 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 1/16/2023 5:17:09 PM |
Identificators
| InChI | InChI=1S/C20H26N4O2/c1-5-21-20(25)22-16-7-6-15(12-16)19-13(2)23-24(14(19)3)17-8-10-18(26-4)11-9-17/h6-11,15-16H,5,12H2,1-4H3,(H2,21,22,25)/t15-,16-/m1/s1 |
| InChI Key | ISOLYYIFGLDVGJ-HZPDHXFCSA-N |
| Canonical SMILES | CCNC(=O)NC1CC(C=C1)C2=C(N(N=C2C)C3=CC=C(C=C3)OC)C |
| CAS | |
| Splash | |
| Other Names | NAT16-352850 |